5-(4-propan-2-yloxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide

C23H26N4O2 — CID 109291937

IUPAC5-(4-propan-2-yloxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide
SMILESCC(C)Oc1ccc(Nc2cnc(C(=O)Nc3ccccc3C(C)C)cn2)cc1
InChIInChI=1S/C23H26N4O2/c1-15(2)19-7-5-6-8-20(19)27-23(28)21-13-25-22(14-24-21)26-17-9-11-18(12-10-17)29-16(3)4/h5-16H,1-4H3,(H,25,26)(H,27,28)
InChIKeyOOBWEWFARTXREN-UHFFFAOYSA-N
MW390.49 g/mol
LogP5.38
Rot. Bonds7

About 5-(4-propan-2-yloxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide

5-(4-propan-2-yloxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide (PubChem CID 109291937) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is 5-(4-propan-2-yloxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(4-propan-2-yloxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide
PubChem CID109291937
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC Name5-(4-propan-2-yloxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide
SMILESCC(C)Oc1ccc(Nc2cnc(C(=O)Nc3ccccc3C(C)C)cn2)cc1
InChIInChI=1S/C23H26N4O2/c1-15(2)19-7-5-6-8-20(19)27-23(28)21-13-25-22(14-24-21)26-17-9-11-18(12-10-17)29-16(3)4/h5-16H,1-4H3,(H,25,26)(H,27,28)
InChIKeyOOBWEWFARTXREN-UHFFFAOYSA-N
XLogP5.38
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.49
LogP ≤ 55.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(4-methoxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109291932
N-(2-ethylphenyl)-5-(4-propan-2-yloxyanilino)pyrazine-2-carboxamide
CID 109291492
5-(4-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293748
5-(4-methoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293616
5-(4-acetylanilino)-N-(4-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293861
5-(2-ethoxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109291933
5-[4-(dimethylamino)anilino]-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293832
N-(2,4-dimethoxyphenyl)-5-(2-propan-2-ylanilino)pyrazine-2-carboxamide
CID 109291979
5-(4-ethoxyanilino)-N-phenylpyrazine-2-carboxamide
CID 109289463
N-(2-fluorophenyl)-5-(4-propan-2-ylanilino)pyrazine-2-carboxamide
CID 109292042
5-(3-methoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293523
5-(5-chloro-2-methylanilino)-N-(4-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293034

Frequently Asked Questions

What is the IUPAC name of 5-(4-propan-2-yloxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(4-propan-2-yloxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide (CID 109291937) is 5-(4-propan-2-yloxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(4-propan-2-yloxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(4-propan-2-yloxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide is CC(C)Oc1ccc(Nc2cnc(C(=O)Nc3ccccc3C(C)C)cn2)cc1.
What is the InChIKey of 5-(4-propan-2-yloxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide?
The InChIKey is OOBWEWFARTXREN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2/c1-15(2)19-7-5-6-8-20(19)27-23(28)21-13-25-22(14-24-21)26-17-9-11-18(12-10-17)29-16(3)4/h5-16H,1-4H3,(H,25,26)(H,27,28).
What are the key properties of 5-(4-propan-2-yloxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide?
5-(4-propan-2-yloxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide has a molecular weight of 390.49 g/mol, XLogP of 5.38, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-propan-2-yloxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109291937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).